4E3Z
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![BU of 4e3z by Molmil](/molmil-images/mine/4e3z) | Crystal Structure of a oxidoreductase from Rhizobium etli CFN 42 | Descriptor: | Putative oxidoreductase protein | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2012-03-11 | Release date: | 2012-03-21 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Crystal Structure of a oxidoreductase from Rhizobium etli CFN 42 To be Published
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2I9U
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![BU of 2i9u by Molmil](/molmil-images/mine/2i9u) | |
7K40
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![BU of 7k40 by Molmil](/molmil-images/mine/7k40) | Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) in Complex with Covalent Inhibitor Boceprevir at 1.35 A Resolution | Descriptor: | 3C-like proteinase, DIMETHYL SULFOXIDE, boceprevir (bound form) | Authors: | Kumaran, D, Andi, B, Kreitler, D.F, Soares, A.S, Shi, W, Jakoncic, J, Fuchs, M.R, Keereetaweep, J, Shanklin, J, McSweeney, S. | Deposit date: | 2020-09-14 | Release date: | 2020-09-23 | Last modified: | 2023-10-18 | Method: | X-RAY DIFFRACTION (1.35 Å) | Cite: | Hepatitis C virus NS3/4A inhibitors and other drug-like compounds as covalent binders of SARS-CoV-2 main protease. Sci Rep, 12, 2022
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3QW5
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![BU of 3qw5 by Molmil](/molmil-images/mine/3qw5) | Crystal structure of the protease domain of Botulinum Neurotoxin Serotype A with a peptide inhibitor RRGF | Descriptor: | Botulinum neurotoxin type A, SULFATE ION, ZINC ION, ... | Authors: | Kumaran, D, Swaminathan, S. | Deposit date: | 2011-02-26 | Release date: | 2012-02-08 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling. Acta Crystallogr.,Sect.D, 68, 2012
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3QW8
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![BU of 3qw8 by Molmil](/molmil-images/mine/3qw8) | Crystal structure of the protease domain of Botulinum Neurotoxin Serotype A with a peptide inhibitor CRGC | Descriptor: | 1,2-ETHANEDIOL, Botulinum neurotoxin type A, SODIUM ION, ... | Authors: | Kumaran, D, Swaminathan, S. | Deposit date: | 2011-02-27 | Release date: | 2012-02-08 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling. Acta Crystallogr.,Sect.D, 68, 2012
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3SQS
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![BU of 3sqs by Molmil](/molmil-images/mine/3sqs) | |
4J2U
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![BU of 4j2u by Molmil](/molmil-images/mine/4j2u) | Crystal structure of an enoyl-CoA hydratase from Rhodobacter sphaeroides 2.4.1 | Descriptor: | Enoyl-CoA hydratase | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Al Obaidi, N, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2013-02-05 | Release date: | 2013-02-20 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Crystal structure of an enoyl-CoA hydratase from Rhodobacter sphaeroides 2.4.1 To be Published
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3T61
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![BU of 3t61 by Molmil](/molmil-images/mine/3t61) | Crystal Structure of a gluconokinase from Sinorhizobium meliloti 1021 | Descriptor: | Gluconokinase, PHOSPHATE ION | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, LaFleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2011-07-28 | Release date: | 2011-08-17 | Last modified: | 2012-03-21 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Crystal Structure of a gluconokinase from Sinorhizobium meliloti 1021 To be Published
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4HY3
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![BU of 4hy3 by Molmil](/molmil-images/mine/4hy3) | Crystal structure of a phosphoglycerate oxidoreductase from rhizobium etli | Descriptor: | phosphoglycerate oxidoreductase | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2012-11-12 | Release date: | 2012-12-12 | Method: | X-RAY DIFFRACTION (2.8 Å) | Cite: | Crystal structure of a phosphoglycerate oxidoreductase from rhizobium etli To be Published
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4JFC
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![BU of 4jfc by Molmil](/molmil-images/mine/4jfc) | Crystal structure of a enoyl-CoA hydratase from Polaromonas sp. JS666 | Descriptor: | Enoyl-CoA hydratase, GLYCEROL | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Al Obaidi, N, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2013-02-28 | Release date: | 2013-05-01 | Method: | X-RAY DIFFRACTION (2.25 Å) | Cite: | Crystal structure of a enoyl-CoA hydratase from Polaromonas sp. JS666 To be Published
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4JCU
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![BU of 4jcu by Molmil](/molmil-images/mine/4jcu) | Crystal structure of a 5-carboxymethyl-2-hydroxymuconate isomerase from Deinococcus radiodurans R1 | Descriptor: | 5-carboxymethyl-2-hydroxymuconate isomerase | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Al Obaidi, N, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2013-02-22 | Release date: | 2013-03-13 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Crystal structure of a 5-carboxymethyl-2-hydroxymuconate isomerase from Deinococcus radiodurans R1 To be Published
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3QW7
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![BU of 3qw7 by Molmil](/molmil-images/mine/3qw7) | Crystal structure of the protease domain of Botulinum Neurotoxin Serotype A with a peptide inhibitor RRFC | Descriptor: | Botulinum neurotoxin type A, SODIUM ION, SULFATE ION, ... | Authors: | Kumaran, D, Swaminathan, S. | Deposit date: | 2011-02-27 | Release date: | 2012-02-08 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling. Acta Crystallogr.,Sect.D, 68, 2012
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3QW6
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![BU of 3qw6 by Molmil](/molmil-images/mine/3qw6) | Crystal structure of the protease domain of Botulinum Neurotoxin Serotype A with a peptide inhibitor RYGC | Descriptor: | Botulinum neurotoxin type A, SODIUM ION, SULFATE ION, ... | Authors: | Kumaran, D, Swaminathan, S. | Deposit date: | 2011-02-26 | Release date: | 2012-02-08 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling. Acta Crystallogr.,Sect.D, 68, 2012
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4ZJX
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1YT8
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![BU of 1yt8 by Molmil](/molmil-images/mine/1yt8) | |
1Y9I
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![BU of 1y9i by Molmil](/molmil-images/mine/1y9i) | Crystal structure of low temperature requirement C protein from Listeria monocytogenes | Descriptor: | CALCIUM ION, GLYCEROL, MAGNESIUM ION, ... | Authors: | Kumaran, D, Swaminathan, S, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC) | Deposit date: | 2004-12-15 | Release date: | 2004-12-28 | Last modified: | 2021-02-03 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Crystal structure of phosphatidylglycerophosphatase (PGPase), a putative membrane-bound lipid phosphatase, reveals a novel binuclear metal binding site and two "proton wires". Proteins, 64, 2006
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1YBD
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1Y9Q
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![BU of 1y9q by Molmil](/molmil-images/mine/1y9q) | |
1YAV
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![BU of 1yav by Molmil](/molmil-images/mine/1yav) | |
2AFA
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![BU of 2afa by Molmil](/molmil-images/mine/2afa) | |
2OG9
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![BU of 2og9 by Molmil](/molmil-images/mine/2og9) | |
2PGW
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![BU of 2pgw by Molmil](/molmil-images/mine/2pgw) | |
2P9B
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2QS8
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![BU of 2qs8 by Molmil](/molmil-images/mine/2qs8) | Crystal structure of a Xaa-Pro dipeptidase with bound methionine in the active site | Descriptor: | MAGNESIUM ION, METHIONINE, Xaa-Pro Dipeptidase | Authors: | Kumaran, D, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) | Deposit date: | 2007-07-30 | Release date: | 2007-08-21 | Last modified: | 2021-02-03 | Method: | X-RAY DIFFRACTION (2.33 Å) | Cite: | Functional annotation of two new carboxypeptidases from the amidohydrolase superfamily of enzymes. Biochemistry, 48, 2009
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4LK5
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![BU of 4lk5 by Molmil](/molmil-images/mine/4lk5) | Crystal structure of a enoyl-CoA hydratase from Mycobacterium avium subsp. paratuberculosis K-10 | Descriptor: | enoyl-CoA hydratase | Authors: | Kumaran, D, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, Lafleur, J, Seidel, R, Villigas, G, Zencheck, W, Al Obaidi, N, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) | Deposit date: | 2013-07-06 | Release date: | 2013-07-24 | Method: | X-RAY DIFFRACTION (2.5 Å) | Cite: | Crystal structure of a enoyl-CoA hydratase from Mycobacterium avium subsp. paratuberculosis K-10 To be Published
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